ID: 127408
SMILES:c12c(OC)cc(O)cc1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.662
InChIKey:MTJFYDONBDGRHM-UHFFFAOYSA-N
ID: 127409
SMILES:c12c(OC(CCCC)=O)cc(C)cc1OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.929
InChIKey:YZRCYZGSCOVKQR-UHFFFAOYSA-N
ID: 127410
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127411
SMILES:COc1cc(C=CC(=O)C)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.233
InChIKey:ACKCYOIQWSCDNC-UHFFFAOYSA-N
ID: 127412
SMILES:C1CC(C)=CCCC(C)=CC(c2c(OC)cc(O)cc2C)C1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.605
InChIKey:AULQHXXCUNDXQL-UHFFFAOYSA-N
ID: 127413
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 127414
SMILES:CC1(CCC2=C(C)C=CCC2(C)C)Oc2c(ccc(C)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.465
CB1 binding score: -15.305
InChIKey:XHHMWDPAXPAPEH-UHFFFAOYSA-N
ID: 127415
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C(C(OC)=O)CCC2C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.947
InChIKey:RHVSHJONQYKOQW-UHFFFAOYSA-N
ID: 127416
SMILES:C1(CC(C=C(C)C)=O)(C)OC1CCC1(C)C=Cc2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -13.139
InChIKey:UXVVBTSVKUKRHB-UHFFFAOYSA-N
ID: 127417
SMILES:CC(C)=CCC12c3c(cc(CCCCC)cc3OC1(C)CCC=C(C)C)C(=O)c1cc(O)ccc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.668
CB1 binding score: -14.163
InChIKey:BIJFTBXOUBLYNM-UHFFFAOYSA-N
ID: 127418
SMILES:C1(C)(C)C2(CCC(CO)=CC2)c2c(O)cc(C)cc2OC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.822
InChIKey:IZOOTHJFLRRKDB-UHFFFAOYSA-N
ID: 127419
SMILES:Oc1cc(C)cc(OC)c1C1C(C(C)(C)C(=O)c2cc(C)c(O)c(C)c2)CCC(C)(CCC=C(C#CC=C(C)C)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.786
CB1 binding score: -17.21
InChIKey:SBNYROZAPRYILR-UHFFFAOYSA-N
ID: 127420
SMILES:C12(C)C(C([N+]#C)(C(C)C)CC1)Cc1c(cc(CCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.449
CB1 binding score: -15.972
InChIKey:IVZQSBFQQRYYDK-UHFFFAOYSA-O
ID: 127421
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127422
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC(C(C)(O)C)CC1C)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -15.929
InChIKey:AMCKIQNQNUXZHG-UHFFFAOYSA-N
ID: 127423
SMILES:c1(OC)cc(O)c(C2C=C(C)CCC2C(CO)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.981
InChIKey:ALUZRXUVAYTOOL-UHFFFAOYSA-N
ID: 127424
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C(CC)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.501
InChIKey:NBJACOOWWWSXJN-UHFFFAOYSA-N
ID: 127425
SMILES:COc1cc(CCCCC)cc2c1C1CC(C)(C)CCCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.16
InChIKey:HAOLOUDNNZNOKJ-UHFFFAOYSA-N
ID: 127426
SMILES:C1CC2(C)C(C3(C)OC4OC(C13)c1c(cc(CCCCC)cc1O)OC(C=C(C)C)C4)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.605
InChIKey:IEQPEJIWIOCVFZ-UHFFFAOYSA-N
ID: 127427
SMILES:CC1(C)C(CCC(C)CCCC(CCc2c(O)cc(C)cc2O)(C)O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -14.309
InChIKey:MKRNBXDURPOZEV-UHFFFAOYSA-N
ID: 127428
SMILES:O1C2C=C(C)CCC22c3c(cc(CCCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.375
InChIKey:QQVHSDIWQWCIAW-UHFFFAOYSA-N